SCHEMBL4640959

SCHEMBL4640959

CCCC(CC)OC(=O)c1ccc(F)cc1C(=O)OC(CC)CCC

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 2/20 0.50
PRKCD Q05655 2/20 0.50
ALDH1A1 P00352 6/20 0.39
TSHR P16473 3/20 0.39
MAPK1 P28482 2/20 0.39
HPGD P15428 3/20 0.36
CES2 O00748 2/20 0.35
CES1 P23141 2/20 0.35
CA2 P00918 1/20 0.35
CYP3A4 P08684 1/20 0.35
KDM4E B2RXH2 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4640962 0.93 PRKCA (0.47) PRKCAPRKCDALDH1A1TSHRMAPK1
SCHEMBL4642972 0.89 PRKCA (0.39) PRKCAPRKCDALDH1A1TSHRMAPK1
SCHEMBL4640908 0.84 PRKCA (0.51) PRKCAPRKCDALDH1A1TSHRMAPK1
SCHEMBL4641003 0.84 PRKCA (0.55) PRKCAPRKCDALDH1A1TSHRMAPK1
SCHEMBL4642973 0.82 ALDH1A1 (0.40) PRKCAPRKCDALDH1A1HPGDKDM4E
SCHEMBL4639972 0.82 PRKCA (0.50) PRKCAPRKCDALDH1A1TSHRMAPK1
SCHEMBL4640709 0.82 PRKCA (0.50) PRKCAPRKCDALDH1A1TSHRMAPK1
SCHEMBL4640700 0.82 PRKCA (0.50) PRKCAPRKCDALDH1A1TSHRMAPK1
SCHEMBL234033 0.81 PRKCA (0.54) PRKCAPRKCDALDH1A1TSHRMAPK1
SCHEMBL4640735 0.80 ALDH1A1 (0.41) PRKCAPRKCDALDH1A1TSHRMAPK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1188739-B1 PHTHALIC DIESTER DERIVATIVES AND ELECTRON DONORS TOHO TITANIUM CO LTD (JP) 2008-08-13 EP disclosed
US-6670497-B2 Dialkyl (at least one of which is a C4-8 tertiary alkyl) ester of an alkyl- or halo-substituted phthalic acid; used in an olefin polymerization catalyst TOHO TITANIUM CO., LTD. (JP) 2003-12-30 US disclosed
US-20030036594-A1 Phthalic diester derivatives and electron donors TOHO TITANIUM CO., LTD. (JP) 2003-02-20 US disclosed
EP-1188739-A1 PHTHALIC DIESTER DERIVATIVES AND ELECTRON DONORS TOHO TITANIUM CO., LTD. (JP) 2002-03-20 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030036594-A1 Phthalic diester derivatives and electron donors HPD, ETFA, PPOX PRKCA 1200/4885PRKCD 552/4885ALDH1A1 725/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.